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pro vyhledávání: '"Khrapak, A."'
Autor:
Khrapak, S. A., Khrapak, A. G.
Publikováno v:
Phys. Rev. E 110, 054101 (2024)
We calculate the shear relaxation times in four important simple monatomic model fluids: Lennard-Jones, Yukawa, soft-sphere and hard-sphere fluids. It is observed that in properly reduced units, the shear relaxation times exhibit quasi-universal beha
Externí odkaz:
http://arxiv.org/abs/2412.07663
Autor:
Khrapak, Sergey, Khrapak, Alexey
Publikováno v:
JETP Letters 120, 236 (2024)
A simple and popular Bridgman's formula predicts a linear correlation between the thermal conductivity coefficient and the sound velocity of dense liquids. Unfortunately, it cannot be applied to strongly coupled plasma-related fluids, because the sou
Externí odkaz:
http://arxiv.org/abs/2409.16193
Autor:
Khrapak, Sergey
Publikováno v:
Physical Review E 110, 034602 (2024)
The entropy of strongly coupled Yukawa fluids is discussed from several perspectives. First, it is demonstrated that a vibrational paradigm of atomic dynamics in dense fluids can be used to obtain a simple and accurate estimate of the entropy without
Externí odkaz:
http://arxiv.org/abs/2409.10645
Autor:
Khrapak, S. A., Khrapak, A. G.
Publikováno v:
The Journal of Chemical Physics 160, 134504 (2024)
It is shown that the transport coefficients (self-diffusion, shear viscosity, and thermal conductivity) of the Weeks-Chandler-Anderson (WCA) fluid along isotherms exhibit a freezing density scaling (FDS). The functional form of this FDS is essentiall
Externí odkaz:
http://arxiv.org/abs/2404.16603
Autor:
Khrapak, S. A., Khrapak, A. G.
Publikováno v:
Phys. Rev. E 108, 064129 (2023)
Exact mechanisms of thermal conductivity in liquids are not well understood, despite rich research history. A vibrational model of energy transfer in dense simple liquids with soft pairwise interactions seems adequate to partially fill this gap. The
Externí odkaz:
http://arxiv.org/abs/2402.03020
Autor:
Khrapak, Sergey
Publikováno v:
The Journal of Chemical Physics 160, 166101 (2024)
A modified shoving model is applied to estimate the location of the glass transition in a one-component plasma. The estimated value of the coupling parameter $\Gamma\simeq 570$ at the glass transition is compared with other predictions available in t
Externí odkaz:
http://arxiv.org/abs/2405.08665
Autor:
Khrapak, Sergey
Publikováno v:
J. Phys. Chem. B 128, 287-290 (2024)
A practical correction formula relating the self-diffusion coefficient of dense liquids from molecular dynamics simulations with periodic boundary conditions to the self-diffusion coefficient in the thermodynamic limit is discussed. This formula appl
Externí odkaz:
http://arxiv.org/abs/2402.09348
Autor:
Khrapak, Sergey
Publikováno v:
Physics Reports 1050, 1 (2024)
A vibrational model of transport properties of dense fluids assumes that solid-like oscillations of atoms around their temporary equilibrium positions dominate the dynamical picture. The temporary equilibrium positions of atoms do not form any regula
Externí odkaz:
http://arxiv.org/abs/2401.03871
Autor:
Khrapak, Sergay, Khrapak, Alexey
Publikováno v:
J. Chem. Phys. 158, 206101 (2023)
It is demonstrated that self-diffusion and shear viscosity data for the TIP4P/Ice water model reported recently [L. Baran, W. Rzysko and L. MacDowell, J. Chem. Phys. {\bf 158}, 064503 (2023)] obey the microscopic version of the Stokes-Einstein relati
Externí odkaz:
http://arxiv.org/abs/2308.00653
Autor:
Khrapak, Sergey1 (AUTHOR) khrapak@mail.ru, Khrapak, Alexey1 (AUTHOR)
Publikováno v:
Molecules. Dec2024, Vol. 29 Issue 23, p5587. 7p.